Structure Information
Structure

Compound Identification

SMILES

FC1=CC2=C(C=C1)N=C(S2)N1C(C(C(=O)C2=CC=CO2)C(=O)C1=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=BHAHZKXMMMDWTE-UHFFFAOYSA-N

Formula

C22H12BrFN2O4S

Mass

499.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolidines

Subclass

Phenylpyrrolidines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylpyrrolidine - 1,3-benzothiazole - Aryl ketone - Aryl alkyl ketone - Halobenzene - Bromobenzene - 1,3-diketone - Aryl fluoride - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Benzenoid - Furan - Heteroaromatic compound - Pyrrole - Azole - Tertiary carboxylic acid amide - Thiazole - Cyclic ketone - Carboxamide group - Ketone - Lactam - Oxacycle - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organobromide - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.

External Descriptors

Not available

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